In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 17 | Yes |
Popular Name: N-[[(6S)-6-isopropyl-4,5,6,7-tetrahydro-1H-benzimidazol-2-yl]methyl]propan-1-amine N-[[(6S)-6-isopropyl-4,5,6,7-tet…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.68 | 6.2 | -26.15 | 3 | 3 | 1 | 42 | 236.383 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.68 | 6.82 | -39.99 | 3 | 3 | 1 | 45 | 236.383 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.